OpenMD 3.1
Molecular Dynamics in the Open
|
Public Member Functions | |
virtual std::vector< RealType > | getLatticeConstant () |
virtual void | setLatticeConstant (const std::vector< RealType > &lc) |
Public Member Functions inherited from OpenMD::Lattice | |
int | getNumSitesPerCell () |
void | getLatticePointsPos (std::vector< Vector3d > &latticePos, int nx, int ny, int nz) |
std::vector< Vector3d > | getLatticePointsOrt () |
Vector3d | getOrigin () |
void | setOrigin (const Vector3d &newOrigin) |
Protected Attributes | |
RealType | latticeParam |
Protected Attributes inherited from OpenMD::Lattice | |
int | nCellSites |
Vector3d | origin |
std::vector< Vector3d > | cellSitesPos |
std::vector< Vector3d > | cellSitesOrt |
Vector3d | cellLen |
Additional Inherited Members | |
Protected Member Functions inherited from OpenMD::Lattice | |
virtual void | update ()=0 |
Definition at line 55 of file CubicLattice.hpp.
|
protected |
Definition at line 51 of file CubicLattice.cpp.
|
virtual |
Implements OpenMD::Lattice.
Definition at line 59 of file CubicLattice.cpp.
|
virtual |
Implements OpenMD::Lattice.
Definition at line 66 of file CubicLattice.cpp.
|
protected |
Definition at line 67 of file CubicLattice.hpp.